Description

2-[(4-Cyanophenyl)Methylsulfanyl]Benzoate is a high-value, specialized organic compound featuring a benzoate ester core linked to a cyanophenyl moiety via a methylsulfanyl bridge. This unique molecular architecture makes it a critical advanced intermediate for the synthesis of complex molecules in research and development. It is primarily sought after by pharmaceutical and agrochemical industries for constructing novel active ingredients, as well as by material scientists exploring functional polymers and liquid crystals.

Application

• Pharmaceutical Intermediate: Key building block in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders or possessing specific receptor binding profiles.
• Agrochemical Research: Used in the development of new-generation herbicides, fungicides, or plant growth regulators, leveraging its bifunctional chemical structure.
• Liquid Crystal & OLED Materials: Serves as a precursor for mesogenic compounds used in display technologies and organic light-emitting diodes (OLEDs) due to its rigid, aromatic core.
• Polymer Modification: Acts as a functional monomer or cross-linking agent to introduce specific chemical properties (e.g., polarity, photoactivity) into advanced polymer systems.
• Organic Synthesis & Catalysis: A versatile reagent in academic and industrial R&D for constructing complex sulfur- and nitrogen-containing heterocycles.
• Chemical Biology Probes: Utilized in the design of molecular probes and tags for studying biological processes and protein interactions.

Basic Information

Product Name	2-[(4-Cyanophenyl)Methylsulfanyl]Benzoate
CAS No.	1815618-13-3
Molecular Formula	C16H11NO2S
Molecular Weight	281.33 g/mol
Synonyms	Methyl 2-[(4-cyanophenyl)methylsulfanyl]benzoate; 2-[(4-Cyanobenzyl)thio]benzoic acid methyl ester; Benzoic acid, 2-[[(4-cyanophenyl)methyl]thio]-, methyl ester; 4-[(2-(Methoxycarbonyl)phenyl)thio]methyl]benzonitrile; Methyl o-[[(4-cyanophenyl)methyl]thio]benzoate
EINECS	Contact for details

Quality Control

Our 2-[(4-Cyanophenyl)Methylsulfanyl]Benzoate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for purity and identity confirmation via IR and NMR spectroscopy, to ensure it meets the high standards required for research and industrial synthesis. Certificates of Analysis (COA) detailing all specifications are provided with every shipment to guarantee traceability and consistency.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). This compound is light-sensitive (store away from light) and should be handled under an inert atmosphere for long-term storage to prevent potential degradation.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Melting Point	Contact for details
Loss on Drying	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	< 20 ppm

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.